SCHEMBL6038344

SCHEMBL6038344

COC(=O)CCc1ccc(S(=O)(=O)N(C)c2ccc(OC)c(OC)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.56
NR1H3 Q13133 1/20 0.56
ALDH1A1 P00352 6/20 0.53
LMNA P02545 2/20 0.49
MAPT P10636 1/20 0.49
BMP1 P13497 1/20 0.49
NR2F2 P24468 1/20 0.48
RAB9A P51151 1/20 0.48
KMT2A Q03164 2/20 0.48
TAS2R14 Q9NYV8 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MCOLN3 Q8TDD5 1/20 0.47
MCL1 Q07820 1/20 0.46
HTT P42858 2/20 0.46
GAA P10253 1/20 0.45

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6038092 0.83 ALDH1A1 (0.50) ALDH1A1LMNAMAPTBMP1NR2F2
SCHEMBL6038082 0.81 ALDH1A1 (0.48) ALDH1A1LMNAMAPTNR2F2RAB9A
SCHEMBL3940302 0.77 KMT2A (0.59) ALDH1A1MAPTKMT2A
SCHEMBL6038095 0.76 LMNA (0.64) ALDH1A1LMNAKMT2ASMN1; SMN2HTT
SCHEMBL8864748 0.76 BMP1 (0.54) ALDH1A1LMNABMP1TAS2R14
SCHEMBL2275943 0.74 KMT2A (0.51) ALDH1A1KMT2ASMN1; SMN2
SCHEMBL6038037 0.74 ALDH1A1 (0.55) ALDH1A1LMNAMAPTNR2F2RAB9A
SCHEMBL6038049 0.73 ALDH1A1 (0.49) NR1H2NR1H3ALDH1A1LMNAKMT2A
SCHEMBL8558353 0.73 ALDH1A1 (0.55) ALDH1A1LMNAMAPTBMP1RAB9A
SCHEMBL8142192 0.72 ALDH1A1 (0.50) ALDH1A1MAPTRAB9ASMN1; SMN2MCL1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060264415-A1 Inhibitors of histone deacetylase METHYLGENE INC. 2006-11-23 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060264415-A1 Inhibitors of histone deacetylase HDAC1, HDAC3, HDAC11 NR1H2 544/4885NR1H3 678/4885ALDH1A1 781/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.